5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine

C15H18BrN3O2 — CID 66302187

IUPAC5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine
SMILESCCNc1nc(-c2cc(OC)ccc2OC)nc(C)c1Br
InChIInChI=1S/C15H18BrN3O2/c1-5-17-15-13(16)9(2)18-14(19-15)11-8-10(20-3)6-7-12(11)21-4/h6-8H,5H2,1-4H3,(H,17,18,19)
InChIKeyJRJAAHGFFRHCOH-UHFFFAOYSA-N
MW352.23 g/mol
LogP3.66
Rot. Bonds5

About 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine

5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine (PubChem CID 66302187) has the molecular formula C15H18BrN3O2 and a molecular weight of 352.23 g/mol. Its IUPAC name is 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine
PubChem CID66302187
Molecular FormulaC15H18BrN3O2
Molecular Weight352.23 g/mol
Exact Mass351.06
IUPAC Name5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine
SMILESCCNc1nc(-c2cc(OC)ccc2OC)nc(C)c1Br
InChIInChI=1S/C15H18BrN3O2/c1-5-17-15-13(16)9(2)18-14(19-15)11-8-10(20-3)6-7-12(11)21-4/h6-8H,5H2,1-4H3,(H,17,18,19)
InChIKeyJRJAAHGFFRHCOH-UHFFFAOYSA-N
XLogP3.66
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.23
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-4-chloro-2-(2,5-dimethoxyphenyl)-6-methylpyrimidine
CID 66313783
2-(2,5-dimethoxyphenyl)-N,5,6-trimethylpyrimidin-4-amine
CID 62201725
5-bromo-2-(4-bromo-2-methylphenyl)-N-ethyl-6-methylpyrimidin-4-amine
CID 103083781
5-bromo-N-ethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306280
5-bromo-N-ethyl-2-[2-(methoxymethyl)phenyl]-6-methylpyrimidin-4-amine
CID 66297841
5-bromo-2-(4-chloro-2-methoxyphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 106819708
5-bromo-2-(2,3-dimethylphenyl)-N-ethyl-6-methylpyrimidin-4-amine
CID 66297457
5-bromo-N-ethyl-2-[4-(methoxymethyl)phenyl]-6-methylpyrimidin-4-amine
CID 66295720
2-(5-bromo-2-methoxyphenyl)-N-ethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62204247
2-(ethylamino)-5-(4-methoxyphenyl)-6-methylpyridine-3-carbonitrile
CID 63271011
4-(2,5-dimethoxyphenyl)-N-ethyl-1,3-thiazol-2-amine
CID 8962407
2-(2,5-dimethoxyphenyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 62913464

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine (CID 66302187) is 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine is CCNc1nc(-c2cc(OC)ccc2OC)nc(C)c1Br.
What is the InChIKey of 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine?
The InChIKey is JRJAAHGFFRHCOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3O2/c1-5-17-15-13(16)9(2)18-14(19-15)11-8-10(20-3)6-7-12(11)21-4/h6-8H,5H2,1-4H3,(H,17,18,19).
What are the key properties of 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine?
5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine has a molecular weight of 352.23 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine is sourced from PubChem (CID 66302187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).